DOI: 10.14469/hpc/7868 Metadata

Created: 2021-02-11 12:18

Last modified: 2021-02-11 13:00

Author: Charles ROMAIN

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

e-CL coordination on dimeric species S,S-II

Embargo

Access code: u3am-tyew

Release embargo

Files

Filename	Size	Type	Description
SS-II_eCL.log	6MB	chemical/x-gaussian-log	log file from Gaussian

Member of collection / collaboration

DOI	Description
10.14469/hpc/6486	DFT Data

Subject Keywords

Keyword	Value
inchi	InChI=1S/2C34H54N2O2.C6H10O2.2CH3O.2Al/c2*1-31(2,3)21-17-23(33(7,8)9)29(37)27(19-21)35-25-15-13-14-16-26(25)36-28-20-22(32(4,5)6)18-24(30(28)38)34(10,11)12;7-6-4-2-1-3-5-8-6;2*1-2;;/h2*17-20,25-26,35-38H,13-16H2,1-12H3;1-5H2;2*1H3;;/q;;3*-1;+3;+4/p-4/t2*25-,26-;;;;;/m00...../s1
inchikey	SMFWDKYDXYIXRQ-XFMGSUJTSA-J

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